{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=updated_at&page=4392","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=updated_at&page=4390","results":[{"id":"jvasp-113449","created_at":"2022-09-04T14:38:48.101033Z","updated_at":"2022-09-04T14:38:48.101062Z","structure_string":"B1 O2\n1.0\n2.313287 0.000000 0.000000\n0.000000 2.901049 0.000000\n0.000000 0.000000 3.786089\nB O\n1 2\ndirect\n0.466661 0.000000 0.000000 B\n-0.033330 0.000000 0.250616 O\n-0.033330 0.000000 0.749386 O\n","nsites":3,"nelements":2,"elements":["B","O"],"chemical_system":"B-O","density":2.7978014831750966,"density_atomic":0.11807171037500601,"volume":25.408287814852002,"volume_molar":5.100409523054386,"formula_full":"B1 O2","formula_reduced":"BO2","formula_anonymous":"AB2","energy_above_hull":2.5102631944444447,"spacegroup":47},{"id":"jvasp-107456","created_at":"2022-09-04T14:38:48.105134Z","updated_at":"2022-09-04T14:38:48.105155Z","structure_string":"La1 Pu3\n1.0\n4.295857 -0.009002 -3.852757\n-0.861963 4.208502 -3.852757\n0.007361 0.009002 5.770447\nLa Pu\n1 3\ndirect\n0.000000 0.000000 0.000000 La\n0.500001 0.500000 -0.000000 Pu\n0.250001 0.750000 0.500000 Pu\n0.750001 0.250000 0.500000 Pu\n","nsites":4,"nelements":2,"elements":["La","Pu"],"chemical_system":"La-Pu","density":13.828605028861178,"density_atomic":0.03824883820147548,"volume":104.57833984211568,"volume_molar":15.744637074408423,"formula_full":"La1 Pu3","formula_reduced":"LaPu3","formula_anonymous":"AB3","energy_above_hull":6.422118749999999,"spacegroup":139},{"id":"jvasp-116400","created_at":"2022-09-04T14:38:48.117062Z","updated_at":"2022-09-04T14:38:48.117079Z","structure_string":"Sr1 Pb1 O1\n1.0\n3.789750 -0.000000 0.000000\n0.000000 3.789750 0.000000\n0.000000 0.000000 7.543884\nSr Pb O\n1 1 1\ndirect\n0.000000 0.000000 0.011593 Sr\n0.000000 0.000000 0.567509 Pb\n0.000000 0.000000 0.294684 O\n","nsites":3,"nelements":3,"elements":["Sr","Pb","O"],"chemical_system":"O-Pb-Sr","density":4.763663657808955,"density_atomic":0.027688863459490405,"volume":108.34680897571276,"volume_molar":21.749324484952457,"formula_full":"Sr1 Pb1 O1","formula_reduced":"SrPbO","formula_anonymous":"ABC","energy_above_hull":0.4470320711111111,"spacegroup":99},{"id":"jvasp-113526","created_at":"2022-09-04T14:38:48.119239Z","updated_at":"2022-09-04T14:38:48.119267Z","structure_string":"Be1 Zn2\n1.0\n4.135286 0.000000 0.727902\n0.000000 2.982837 0.000000\n1.437313 0.000000 3.945313\nBe Zn\n1 2\ndirect\n0.466676 0.000000 -0.200010 Be\n-0.199988 0.000000 0.133325 Zn\n0.133313 0.000000 0.466685 Zn\n","nsites":3,"nelements":2,"elements":["Be","Zn"],"chemical_system":"Be-Zn","density":5.098193495998846,"density_atomic":0.06586998263057009,"volume":45.544265842992765,"volume_molar":9.14246599057875,"formula_full":"Be1 Zn2","formula_reduced":"BeZn2","formula_anonymous":"AB2","energy_above_hull":0.0,"spacegroup":191},{"id":"jvasp-117807","created_at":"2022-09-04T14:38:48.122338Z","updated_at":"2022-09-04T14:38:48.122364Z","structure_string":"In1 Br4 O1\n1.0\n-4.259470 4.259470 2.004392\n4.259470 -4.259470 2.004392\n4.259470 4.259470 -2.004392\nIn Br O\n1 4 1\ndirect\n-0.017940 -0.017940 -0.000000 In\n0.105495 0.668990 0.809998 Br\n0.858991 0.295496 0.190003 Br\n0.668988 0.858991 0.563496 Br\n0.295497 0.105495 0.436505 Br\n0.482064 0.482064 -0.000000 O\n","nsites":6,"nelements":3,"elements":["In","Br","O"],"chemical_system":"Br-In-O","density":5.141926970328211,"density_atomic":0.04124748476066538,"volume":145.46341515887408,"volume_molar":14.600019358617626,"formula_full":"In1 Br4 O1","formula_reduced":"InBr4O","formula_anonymous":"ABC4","energy_above_hull":0.2540933150000002,"spacegroup":87},{"id":"jvasp-114058","created_at":"2022-09-04T14:38:48.124247Z","updated_at":"2022-09-04T14:38:48.124285Z","structure_string":"Ba1 I1\n1.0\n5.922878 -0.000000 0.000000\n-2.961439 5.129362 -0.000000\n-0.000000 0.000000 4.429938\nBa I\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333333 0.666666 0.000000 I\n","nsites":2,"nelements":2,"elements":["Ba","I"],"chemical_system":"Ba-I","density":3.260167045467196,"density_atomic":0.014860595413333306,"volume":134.58410947690217,"volume_molar":40.52422256645774,"formula_full":"Ba1 I1","formula_reduced":"BaI","formula_anonymous":"AB","energy_above_hull":0.1877299999999999,"spacegroup":187},{"id":"jvasp-105153","created_at":"2022-09-04T14:38:48.124352Z","updated_at":"2022-09-04T14:38:48.124381Z","structure_string":"Cs1 Ca3\n1.0\n5.648419 -0.000000 3.261116\n1.882806 5.325380 3.261116\n-0.000000 -0.000000 6.522232\nCs Ca\n1 3\ndirect\n0.000000 0.000000 0.000000 Cs\n0.250000 0.250000 0.250000 Ca\n0.750001 0.750000 0.750000 Ca\n0.500000 0.500000 0.500000 Ca\n","nsites":4,"nelements":2,"elements":["Cs","Ca"],"chemical_system":"Ca-Cs","density":2.142570800182131,"density_atomic":0.020388545293238157,"volume":196.18859229386004,"volume_molar":29.53688295749691,"formula_full":"Cs1 Ca3","formula_reduced":"CsCa3","formula_anonymous":"AB3","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-116939","created_at":"2022-09-04T14:38:48.124972Z","updated_at":"2022-09-04T14:38:48.124998Z","structure_string":"Co4 Bi4 O12\n1.0\n5.342710 -0.000000 0.000000\n0.000000 5.513030 0.000000\n-0.000000 -0.000000 7.586729\nCo Bi O\n4 4 12\ndirect\n0.500000 0.000000 -0.000000 Co\n-0.000000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Co\n-0.000000 0.500000 -0.000000 Co\n0.510181 0.555292 0.250000 Bi\n0.989819 0.055292 0.250000 Bi\n0.489819 0.444708 0.750000 Bi\n0.010181 0.944708 0.750000 Bi\n0.296878 0.706580 0.541454 O\n0.203122 0.206580 0.958546 O\n0.296878 0.706580 0.958546 O\n0.203122 0.206580 0.541454 O\n0.703122 0.293420 0.458546 O\n0.083541 0.474891 0.250000 O\n0.916459 0.525109 0.750000 O\n0.583541 0.025109 0.750000 O\n0.796878 0.793420 0.458546 O\n0.416459 0.974891 0.250000 O\n0.796878 0.793420 0.041454 O\n0.703122 0.293420 0.041454 O\n","nsites":20,"nelements":3,"elements":["Co","Bi","O"],"chemical_system":"Bi-Co-O","density":9.390060739070371,"density_atomic":0.0895000889966348,"volume":223.46346494417455,"volume_molar":6.728642203055723,"formula_full":"Co4 Bi4 O12","formula_reduced":"CoBiO3","formula_anonymous":"ABC3","energy_above_hull":2.184717139999999,"spacegroup":62},{"id":"jvasp-107526","created_at":"2022-09-04T14:38:48.131011Z","updated_at":"2022-09-04T14:38:48.131033Z","structure_string":"Sm1 Er1 Fe4\n1.0\n4.423384 -0.000000 2.553842\n1.474461 4.170406 2.553842\n-0.000000 -0.000000 5.107684\nSm Er Fe\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Sm\n0.250000 0.250000 0.250000 Er\n0.624647 0.624648 0.126056 Fe\n0.624647 0.126057 0.624647 Fe\n0.126056 0.624648 0.624647 Fe\n0.624647 0.624648 0.624647 Fe\n","nsites":6,"nelements":3,"elements":["Sm","Er","Fe"],"chemical_system":"Er-Fe-Sm","density":9.53429443817905,"density_atomic":0.06367870902590363,"volume":94.22301569523468,"volume_molar":9.457071055806543,"formula_full":"Sm1 Er1 Fe4","formula_reduced":"SmErFe4","formula_anonymous":"ABC4","energy_above_hull":3.0570401458333336,"spacegroup":216},{"id":"jvasp-114064","created_at":"2022-09-04T14:38:48.132362Z","updated_at":"2022-09-04T14:38:48.132384Z","structure_string":"Al2 Cl1\n1.0\n5.007071 0.000000 -0.000000\n-2.503536 4.336251 -0.000000\n-0.000000 0.000000 2.951675\nAl Cl\n2 1\ndirect\n0.333333 0.666666 0.000000 Al\n0.666666 0.333333 0.000000 Al\n0.000000 0.000000 0.000000 Cl\n","nsites":3,"nelements":2,"elements":["Al","Cl"],"chemical_system":"Al-Cl","density":2.316850499108807,"density_atomic":0.04681171529966584,"volume":64.08652152127857,"volume_molar":12.86460178066363,"formula_full":"Al2 Cl1","formula_reduced":"Al2Cl","formula_anonymous":"AB2","energy_above_hull":1.0176398891666667,"spacegroup":191},{"id":"jvasp-115666","created_at":"2022-09-04T14:38:48.134755Z","updated_at":"2022-09-04T14:38:48.134792Z","structure_string":"Ga1 Bi1 O2\n1.0\n1.792928 1.035147 6.696503\n-1.792928 1.035147 6.696503\n0.000000 -2.070295 6.696503\nGa Bi O\n1 1 2\ndirect\n0.500002 0.500002 0.499997 Ga\n0.000000 0.000000 0.000000 Bi\n0.395917 0.395917 0.395913 O\n0.604087 0.604087 0.604081 O\n","nsites":4,"nelements":3,"elements":["Ga","Bi","O"],"chemical_system":"Bi-Ga-O","density":6.918773135626973,"density_atomic":0.053640850594107184,"volume":74.57003301956266,"volume_molar":11.226780883041354,"formula_full":"Ga1 Bi1 O2","formula_reduced":"GaBiO2","formula_anonymous":"ABC2","energy_above_hull":1.06953590625,"spacegroup":166},{"id":"jvasp-110906","created_at":"2022-09-04T14:38:48.136579Z","updated_at":"2022-09-04T14:38:48.136605Z","structure_string":"Lu6 Fe1 Bi2\n1.0\n8.103195 -0.000000 0.000000\n-4.051597 7.017573 0.000000\n0.000000 -0.000000 4.074705\nLu Fe Bi\n6 1 2\ndirect\n0.229101 0.000000 0.500001 Lu\n-0.000000 0.229101 0.500001 Lu\n0.770898 0.770898 0.500001 Lu\n0.619066 0.000000 -0.000000 Lu\n-0.000000 0.619066 -0.000000 Lu\n0.380933 0.380933 -0.000000 Lu\n0.000000 0.000000 0.000000 Fe\n0.333333 0.666666 0.500001 Bi\n0.666666 0.333333 0.500001 Bi\n","nsites":9,"nelements":3,"elements":["Lu","Fe","Bi"],"chemical_system":"Bi-Fe-Lu","density":10.919000437109215,"density_atomic":0.03884213631102919,"volume":231.7071318614486,"volume_molar":15.50414403517249,"formula_full":"Lu6 Fe1 Bi2","formula_reduced":"Lu6FeBi2","formula_anonymous":"AB2C6","energy_above_hull":1.6945798444444444,"spacegroup":189}]}